Chemical Properties of sulfadimethoxine

sulfadimethoxine

InChI
InChI=1S/C12H14N4O4S/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)
InChI Key
ZZORFUFYDOWNEF-UHFFFAOYSA-N
Formula
C12H14N4O4S
SMILES
COc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(OC)n1
Molecular Weight1
310.33
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Physical Properties

Property Value Unit Source
ω 0.8598 Relay (1.0) Calculated Property
ΔfG° 49.56 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -438.77 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 119.39 kJ/mol Relay (1.0) Calculated Property
IE 7.85 eV Relay (1.0) Calculated Property
log10WS -2.96 Aq. Solubility Prediction
logPoct/wat 0.877 Crippen Calculated Property
McVol 212.170 ml/mol McGowan Calculated Property
Pc 2918.34 kPa Relay (1.0-beta) Calculated Property
Tboil 686.52 K Relay (1.0) Calculated Property
Tc 1033.14 K Relay (1.0) Calculated Property
Tfus 476.98 K Aq. Solubility Prediction
Vc 0.756 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

sulfamethomidine. 1H-Indole-3-ethanol, 2-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-, [1S-(1«alpha»,2«alpha»,4«alpha»,5«beta»)]-. Quinine, trimethylsilyl ether. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-acetyl. xanthosine-5'-monophosphate, TMS. Retroisosensine. inosine-5'-monophosphate, TMS. risperidone. (E)-Eruciflorine. 21-Hydroxyintergerrimine. N-Desmethylmirtazapine. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. Eruciflorine. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-acetyl.

Find more compounds similar to sulfadimethoxine.

Sources

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